CID 9578652

1-phenacyloxime-2-methylquinolinium chloride

Structural Information

Molecular Formula
C18H17N2O
SMILES
CC1=[N+](C2=CC=CC=C2C=C1)C/C(=N/O)/C3=CC=CC=C3
InChI
InChI=1S/C18H16N2O/c1-14-11-12-16-9-5-6-10-18(16)20(14)13-17(19-21)15-7-3-2-4-8-15/h2-12H,13H2,1H3/p+1/b19-17-
InChIKey
LTAURTCUWAXQQN-ZPHPHTNESA-O
Compound name
(NE)-N-[2-(2-methylquinolin-1-ium-1-yl)-1-phenylethylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.1341 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.14138 163.0
[M+Na]+ 300.12332 180.7
[M+NH4]+ 295.16792 173.2
[M+K]+ 316.09726 172.2
[M-H]- 276.12682 170.5
[M+Na-2H]- 298.10877 174.1
[M]+ 277.13355 168.2
[M]- 277.13465 168.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.